SCHEMBL5581933

SCHEMBL5581933

CNc1ncc2c(-c3cc(Cl)cc(Cl)c3)cc(Br)c(OC)c2n1

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CCR4 P51679 1/20 0.33
NQO2 P16083 1/20 0.32
EGFR P00533 1/20 0.32
CSNK2A2 P19784 1/20 0.31
CSNK2B P67870 1/20 0.31
CSNK2A1 P68400 1/20 0.31
ULK1 O75385 1/20 0.31
SIK1 P57059 1/20 0.30
SIK2 Q9H0K1 1/20 0.30
SIK3 Q9Y2K2 1/20 0.30
ADORA1 P30542 1/20 0.30
IDO1 P14902 1/20 0.30
TDO2 P48775 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5581955 0.90 CYP17A1 (0.31) NQO2EGFRCSNK2A1SIK1SIK2
SCHEMBL5581980 0.89 NQO2 (0.36) CCR4NQO2EGFRCSNK2A2CSNK2B
SCHEMBL5582085 0.89 CSNK2A2 (0.38) CCR4NQO2EGFRCSNK2A2CSNK2B
SCHEMBL5581881 0.85 KMO (0.37) CCR4NQO2EGFRSIK2IDO1
SCHEMBL5581567 0.85 CSNK2A1 (0.40) CSNK2A1
SCHEMBL5582141 0.84 NQO2 (0.41) NQO2EGFRCSNK2A1ULK1ADORA1
SCHEMBL5581982 0.83 PTK2 (0.36) NQO2EGFR
SCHEMBL5582165 0.83 SIK1 (0.39) CCR4NQO2EGFRCSNK2A2CSNK2B
SCHEMBL5582108 0.81 PAK1 (0.39) NQO2EGFRCSNK2A1ULK1SIK1
SCHEMBL5582011 0.81 PTK2 (0.47) EGFR

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070225308-A1 2-Amino Quinazoline Derivative KYOWA HAKKO KOGYO CO.,LTD. (JP) 2007-09-27 US disclosed
EP-1726584-A1 2-AMINOQUINAZOLINE DERIVATIVE KYOWA HAKKO KOGYO CO., LTD. (JP) 2006-11-29 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070225308-A1 2-Amino Quinazoline Derivative AGTR2, ABL1, AGTR1 CCR4 3108/4885NQO2 7/4885EGFR 1957/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.